%chk=000076487.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076487

0 1
 S   -5.160900     -3.8400002E-02  1.2900000E-02
 P    1.783600     -8.8299997E-02  0.7709000    
 O   0.6798000      -1.074400      0.1232000    
 O    1.755700       1.219700     -0.1859000    
 O    3.190700     -0.8095000      0.4102000    
 O    1.607800      0.1858000       2.237900    
 C  -0.6676000     -0.8355000      9.7499996E-02
 C    2.727300       2.229600      2.3900000E-02
 C    3.498900      -1.131300     -0.9354000    
 C   -1.171700      0.3326000      0.6598000    
 C   -1.521500      -1.762900     -0.4906000    
 C   -3.406600     -0.3500000      4.5600001E-02
 C   -2.545000      0.5760000      0.6340000    
 C   -2.894700      -1.519600     -0.5166000    
 C    2.506200       3.342300     -0.9785000    
 C    4.860700      -1.790500     -0.9854000    
 C   -5.242700       1.514400     -0.9236000    
 H    2.627700       2.615800       1.043200    
 H    3.730200       1.809000     -9.4999999E-02
 H    2.740300      -1.814900      -1.328500    
 H    3.501300     -0.2226000      -1.544000    
 H  -0.5420000       1.081900       1.125100    
 H   -1.126900      -2.674800     -0.9296000    
 H   -2.922100       1.491100       1.083800    
 H   -3.550500      -2.252800     -0.9797000    
 H    3.237800       4.143300     -0.8409000    
 H    2.587800       2.960600      -2.001500    
 H    1.499700       3.760600     -0.8743000    
 H    5.128900      -2.056100      -2.011700    
 H    5.627500      -1.121200     -0.5816000    
 H    4.873500      -2.696700     -0.3709000    
 H   -4.745200       1.401900      -1.890700    
 H   -4.773800       2.328800     -0.3655000    
 H   -6.290700       1.772300      -1.097600    


%chk=000076487-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076487

0 1
S -5.161203 -0.077934 -0.256406
P 2.014298 0.032881 0.706856
O 0.830096 -1.060833 0.042546
O 2.083604 1.192044 -0.576820
O 3.397943 -0.955313 0.571301
O 1.781896 0.627153 2.156440
C -0.559146 -0.750063 0.002615
C 2.384757 2.621517 -0.236071
C 3.724703 -1.633009 -0.729587
C -1.229478 -0.166229 1.102653
C -1.250748 -1.124766 -1.167822
C -3.332024 -0.312383 -0.158613
C -2.622324 0.047322 1.011713
C -2.643644 -0.904555 -1.244102
C 1.998434 3.436934 -1.465490
C 5.061683 -2.329414 -0.504126
C -5.227424 1.799105 -0.501015
H 1.802372 2.907021 0.658922
H 3.463160 2.708536 -0.005906
H 2.912827 -2.344871 -0.960179
H 3.779756 -0.865587 -1.524223
H -0.677821 0.099634 2.010263
H -0.698723 -1.575613 -1.997511
H -3.161316 0.474845 1.863790
H -3.196312 -1.186311 -2.145854
H 2.213938 4.506610 -1.285442
H 2.571757 3.109716 -2.349379
H 0.923076 3.326727 -1.684275
H 5.362556 -2.864136 -1.424294
H 5.847318 -1.598626 -0.248980
H 4.984196 -3.061706 0.316794
H -4.734040 2.073673 -1.445567
H -4.745272 2.307573 0.347762
H -6.295396 2.066258 -0.539494


